#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uqv s SER 25 N 0.00 2.46 -0.37 1.61 0.15 -1.26 -5.11 113.70 111.19 1uqv s SER 25 Ca 0.00 -0.41 -0.18 0.00 0.70 0.00 0.00 55.95 56.06 1uqv s SER 25 Cb 0.00 -0.68 0.00 0.00 -1.71 0.00 0.00 66.02 63.63 1uqv s SER 25 CO 0.00 0.18 0.53 -1.00 1.20 0.00 0.00 173.24 174.15 1uqv s HIS 26 N -0.03 3.16 -0.16 3.44 4.02 -1.26 -5.05 115.29 119.41 1uqv s HIS 26 Ca -0.04 0.12 -0.06 0.00 1.02 0.00 0.00 55.06 56.10 1uqv s HIS 26 Cb -0.12 -2.98 -0.04 0.00 -1.02 0.00 0.00 32.58 28.42 1uqv s HIS 26 CO 0.03 -0.59 0.05 -1.64 1.02 0.00 0.00 174.74 173.60 1uqv s MET 27 N 2.44 3.75 0.38 1.40 1.00 -1.26 -5.11 119.30 121.90 1uqv s MET 27 Ca 0.19 -0.36 0.07 0.00 0.00 0.00 0.00 55.69 55.60 1uqv s MET 27 Cb -0.15 -3.11 -0.01 0.00 0.00 0.00 0.00 34.83 31.56 1uqv s MET 27 CO 0.14 0.38 0.46 -0.80 0.00 0.00 0.00 175.02 175.19 1uqv s ASN 28 N 0.07 5.54 0.56 3.03 -0.87 -1.26 -5.09 114.94 116.91 1uqv s ASN 28 Ca 0.05 -0.44 -0.20 0.00 -1.57 0.00 0.00 52.86 50.69 1uqv s ASN 28 Cb -0.12 -0.84 -0.05 0.00 -0.02 0.00 0.00 41.25 40.22 1uqv s ASN 28 CO 0.01 -0.58 1.19 0.54 -2.57 0.00 0.00 177.10 175.69 1uqv s ASN 29 N -4.20 5.48 0.00 -1.22 4.22 -1.26 -4.94 114.94 113.03 1uqv s ASN 29 Ca 0.49 2.36 0.00 0.00 -2.14 0.00 0.00 52.86 53.56 1uqv s ASN 29 Cb -0.08 -2.60 0.00 0.00 1.28 0.00 0.00 41.25 39.86 1uqv s ASN 29 CO 0.30 -1.39 0.00 1.21 -2.04 0.00 0.00 177.10 175.18 1uqv n GLU 30 N -1.30 0.00 -1.65 3.55 4.07 -1.26 -5.06 120.64 119.00 1uqv n GLU 30 Ca 0.12 0.00 -0.44 0.00 -0.06 0.00 0.00 57.16 56.78 1uqv n GLU 30 Cb 0.49 -0.27 -0.03 0.00 -0.06 0.00 0.00 31.44 31.57 1uqv n GLU 30 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 1uqv n ASP 31 N -2.00 3.81 -0.01 4.31 8.00 -1.26 -4.84 116.55 124.55 1uqv n ASP 31 Ca 0.00 0.77 0.14 0.00 0.71 0.00 0.00 54.79 56.40 1uqv n ASP 31 Cb 0.01 -1.50 0.59 0.00 -0.02 0.00 0.00 41.12 40.20 1uqv n ASP 31 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 1uqv n PHE 32 N 8.25 0.00 0.23 1.24 -1.74 -1.26 -3.37 117.46 120.81 1uqv n PHE 32 Ca 0.23 0.00 0.11 0.00 -0.56 0.00 0.00 57.45 57.23 1uqv n PHE 32 Cb 0.39 -0.38 0.45 0.00 1.52 0.00 0.00 39.48 41.46 1uqv n PHE 32 CO 0.00 0.00 0.00 1.03 -0.56 0.00 0.00 176.76 177.23 1uqv h SER 33 N 0.07 0.00 -0.23 5.98 0.87 -1.88 -2.81 113.55 115.55 1uqv h SER 33 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1uqv h SER 33 Cb 0.44 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.40 1uqv h SER 33 CO 0.00 0.17 0.00 0.00 -0.53 0.00 0.00 176.83 176.47 1uqv n GLN 34 N -3.29 2.15 -2.13 2.24 10.64 -1.22 -4.78 117.38 121.00 1uqv n GLN 34 Ca 0.01 -1.98 -0.41 0.00 -1.83 0.00 0.00 57.00 52.79 1uqv n GLN 34 Cb 0.43 -1.43 -0.02 0.00 -0.86 0.00 0.00 30.24 28.36 1uqv n GLN 34 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.06 173.65 1uqv s TRP 35 N -1.48 3.08 0.46 2.61 0.52 -1.07 -5.04 118.94 118.04 1uqv s TRP 35 Ca 0.30 1.41 0.08 0.00 0.02 0.00 0.00 56.10 57.91 1uqv s TRP 35 Cb 0.19 -3.66 0.08 0.00 -1.15 0.00 0.00 33.47 28.92 1uqv s TRP 35 CO 0.27 -1.81 0.63 -1.13 0.02 0.00 0.00 176.95 174.92 1uqv n SER 36 N 0.93 1.74 -0.14 2.95 3.41 -1.26 -4.25 113.62 116.99 1uqv n SER 36 Ca 0.00 -2.25 0.01 0.00 -0.26 0.00 0.00 58.87 56.37 1uqv n SER 36 Cb 0.42 -0.32 0.29 0.00 -0.26 0.00 0.00 64.21 64.34 1uqv n SER 36 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1uqv h VAL 37 N 0.11 1.17 -0.04 -3.33 2.07 -1.96 -0.72 116.25 113.55 1uqv h VAL 37 Ca -0.22 -0.36 -0.15 0.00 0.82 0.00 0.00 66.70 66.79 1uqv h VAL 37 Cb 1.00 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 1uqv h VAL 37 CO 0.32 0.17 -0.67 -0.78 0.02 0.00 0.00 177.57 176.64 1uqv h ASP 38 N 0.86 0.21 0.02 0.57 3.58 -1.96 -2.48 116.42 117.21 1uqv h ASP 38 Ca 0.23 -0.13 -0.20 0.00 0.42 0.00 0.00 57.03 57.35 1uqv h ASP 38 Cb -0.06 -0.06 0.02 0.00 1.72 0.00 0.00 39.33 40.95 1uqv h ASP 38 CO -0.05 0.81 -0.80 0.44 -2.88 0.00 0.00 179.24 176.77 1uqv h ASP 39 N 0.12 0.66 -0.23 2.28 3.32 -1.77 -2.61 116.42 118.20 1uqv h ASP 39 Ca -0.01 -0.77 -0.04 0.00 0.02 0.00 0.00 57.03 56.22 1uqv h ASP 39 Cb 1.19 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.53 1uqv h ASP 39 CO 0.10 1.36 -0.01 0.58 -1.72 0.00 0.00 179.24 179.55 1uqv h VAL 40 N 0.05 1.26 0.58 -1.35 2.07 -1.20 -2.62 116.25 115.03 1uqv h VAL 40 Ca -0.11 -0.91 -0.03 0.00 0.82 0.00 0.00 66.70 66.47 1uqv h VAL 40 Cb 1.50 1.40 0.01 0.00 -1.52 0.00 0.00 31.29 32.68 1uqv h VAL 40 CO 0.16 0.28 -0.28 0.40 0.02 0.00 0.00 177.57 178.15 1uqv h ILE 41 N 0.17 0.33 -0.01 4.57 2.04 -1.56 -1.57 117.51 121.49 1uqv h ILE 41 Ca 0.06 -0.29 0.02 0.00 1.00 0.00 0.00 64.86 65.65 1uqv h ILE 41 Cb 0.42 0.43 -0.05 0.00 -0.74 0.00 0.00 36.82 36.88 1uqv h ILE 41 CO 0.01 0.04 -0.44 0.74 0.00 0.00 0.00 178.15 178.50 1uqv h THR 42 N -0.99 0.00 -0.56 -0.27 2.02 -1.55 -0.85 112.91 110.72 1uqv h THR 42 Ca -0.08 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.19 1uqv h THR 42 Cb 0.65 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 67.00 1uqv h THR 42 CO 0.13 0.00 0.19 -0.25 0.37 0.00 0.00 175.52 175.96 1uqv h TRP 43 N -0.55 0.33 0.04 3.16 7.01 -1.56 -0.87 115.95 123.51 1uqv h TRP 43 Ca 0.01 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.04 1uqv h TRP 43 Cb 0.59 -0.06 -0.01 0.00 -2.10 0.00 0.00 29.16 27.58 1uqv h TRP 43 CO -0.50 0.08 -0.08 0.00 -2.79 0.00 0.00 178.44 175.16 1uqv h ILE 45 N -0.13 0.45 0.00 0.00 2.04 -1.09 0.88 117.51 119.66 1uqv h ILE 45 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1uqv h ILE 45 Cb 0.12 0.45 0.00 0.00 -0.74 0.00 0.00 36.82 36.65 1uqv h ILE 45 CO -0.03 0.00 0.10 -1.20 0.00 0.00 0.00 178.15 177.01 1uqv n SER 46 N -5.36 0.27 0.00 1.72 7.64 -0.34 -1.49 113.62 116.07 1uqv n SER 46 Ca -0.00 0.57 0.00 0.00 1.01 0.00 0.00 58.87 60.45 1uqv n SER 46 Cb 0.27 -0.59 0.00 0.00 -1.01 0.00 0.00 64.21 62.88 1uqv n SER 46 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1uqv n THR 47 N -1.85 0.15 0.00 0.44 -2.24 -0.06 -4.92 114.28 105.80 1uqv n THR 47 Ca -0.01 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 1uqv n THR 47 Cb 0.11 1.28 0.00 0.00 -2.10 0.00 0.00 70.33 69.62 1uqv n THR 47 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1uqv n LEU 48 N -0.08 0.02 0.05 3.22 0.00 0.29 -5.02 117.00 115.48 1uqv n LEU 48 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 56.01 56.15 1uqv n LEU 48 Cb 0.21 -0.49 0.00 0.00 0.00 0.00 0.00 43.42 43.14 1uqv n LEU 48 CO 0.00 -0.49 0.00 1.21 0.00 0.00 0.00 177.39 178.11 1uqv n GLU 49 N -2.33 0.00 -0.81 1.96 0.00 -1.22 -4.98 120.64 113.27 1uqv n GLU 49 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 1uqv n GLU 49 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.44 1uqv n GLU 49 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.13 178.46 1uqv n VAL 50 N -2.80 0.00 -3.00 6.31 0.24 -1.26 -5.04 118.33 112.78 1uqv n VAL 50 Ca 0.00 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.18 1uqv n VAL 50 Cb 0.00 -0.75 0.04 0.00 -1.47 0.00 0.00 33.84 31.66 1uqv n VAL 50 CO 0.00 0.00 0.00 -1.84 -2.14 0.00 0.00 176.83 172.85 1uqv n GLU 51 N -0.48 0.74 -1.94 7.34 0.28 -1.26 -4.04 120.64 121.28 1uqv n GLU 51 Ca 0.00 -1.84 -0.41 0.00 -0.16 0.00 0.00 57.16 54.75 1uqv n GLU 51 Cb 0.00 -0.16 -0.02 0.00 1.43 0.00 0.00 31.44 32.70 1uqv n GLU 51 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 1uqv n GLU 52 N -1.77 2.61 0.00 3.44 1.02 -1.26 -3.81 120.64 120.88 1uqv n GLU 52 Ca 0.10 -2.68 0.00 0.00 -0.02 0.00 0.00 57.16 54.56 1uqv n GLU 52 Cb 0.36 -3.34 0.00 0.00 -0.02 0.00 0.00 31.44 28.43 1uqv n GLU 52 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1uqv n THR 53 N 5.93 0.00 -1.78 2.62 -2.24 -1.26 -5.11 114.28 112.44 1uqv n THR 53 Ca 0.50 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.90 1uqv n THR 53 Cb 0.42 -0.35 0.04 0.00 -2.10 0.00 0.00 70.33 68.35 1uqv n THR 53 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1uqv s ASP 54 N -4.25 5.28 0.00 3.42 -1.08 -1.25 -4.83 116.67 113.97 1uqv s ASP 54 Ca 0.00 2.77 0.00 0.00 -0.52 0.00 0.00 52.55 54.80 1uqv s ASP 54 Cb 0.00 -2.64 0.00 0.00 -1.46 0.00 0.00 42.92 38.82 1uqv s ASP 54 CO 0.00 -1.56 0.45 -0.81 0.52 0.00 0.00 175.17 173.77 1uqv n PRO 55 N -1.00 0.00 -0.35 4.34 -0.04 -1.26 -2.84 135.00 133.85 1uqv n PRO 55 Ca 0.10 0.05 0.11 0.00 -0.04 0.00 0.00 63.50 63.71 1uqv n PRO 55 Cb 0.45 -1.51 0.30 0.00 -0.04 0.00 0.00 33.50 32.69 1uqv n PRO 55 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1uqv h LEU 56 N 0.00 0.83 -0.77 1.53 5.85 -1.90 0.99 115.31 121.83 1uqv h LEU 56 Ca 0.00 0.07 -0.13 0.00 0.84 0.00 0.00 57.88 58.66 1uqv h LEU 56 Cb 0.03 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 1uqv h LEU 56 CO 0.00 0.37 -0.51 0.00 -0.34 0.00 0.00 178.44 177.96 1uqv h GLN 58 N 0.20 1.08 -0.10 0.00 5.75 -1.05 -0.77 115.11 120.22 1uqv h GLN 58 Ca 0.01 -0.18 -0.07 0.00 -0.15 0.00 0.00 58.65 58.26 1uqv h GLN 58 Cb 0.98 -0.19 0.00 0.00 1.07 0.00 0.00 27.48 29.34 1uqv h GLN 58 CO 0.08 0.87 -0.19 -0.09 -2.65 0.00 0.00 178.83 176.85 1uqv h ARG 59 N 1.06 0.31 0.04 1.69 9.65 -1.30 -2.58 114.38 123.25 1uqv h ARG 59 Ca 0.25 -0.20 -0.00 0.00 -1.10 0.00 0.00 59.98 58.93 1uqv h ARG 59 Cb 0.17 0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.78 1uqv h ARG 59 CO -0.02 0.79 -0.02 -0.07 2.80 0.00 0.00 179.97 183.44 1uqv h LEU 60 N -0.13 -0.05 -0.64 3.80 3.38 -1.36 -2.90 115.31 117.42 1uqv h LEU 60 Ca 0.01 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.03 1uqv h LEU 60 Cb 0.77 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.48 1uqv h LEU 60 CO 0.04 -0.03 0.36 -0.09 0.09 0.00 0.00 178.44 178.81 1uqv h ARG 61 N -0.06 0.66 -0.45 1.13 2.43 -1.22 -2.58 114.38 114.29 1uqv h ARG 61 Ca -0.00 -0.04 0.09 0.00 -0.81 0.00 0.00 59.98 59.22 1uqv h ARG 61 Cb 0.04 -0.15 -0.09 0.00 -0.42 0.00 0.00 29.97 29.35 1uqv h ARG 61 CO 0.01 0.44 -0.16 1.49 -1.51 0.00 0.00 179.97 180.23 1uqv h GLU 62 N 0.68 -0.06 -4.62 0.20 4.81 -1.26 -3.24 114.58 111.09 1uqv h GLU 62 Ca 0.28 0.00 -0.72 0.00 -0.13 0.00 0.00 59.36 58.79 1uqv h GLU 62 Cb 0.14 0.01 -0.20 0.00 0.63 0.00 0.00 28.75 29.33 1uqv h GLU 62 CO -0.16 -0.04 0.56 -0.80 -0.73 0.00 0.00 179.01 177.84 1uqv s ASN 63 N -5.18 6.65 -0.58 1.04 0.01 -0.97 -4.98 114.94 110.93 1uqv s ASN 63 Ca -0.14 -2.22 -0.29 0.00 -0.71 0.00 0.00 52.86 49.50 1uqv s ASN 63 Cb 0.16 -2.33 -0.11 0.00 0.41 0.00 0.00 41.25 39.37 1uqv s ASN 63 CO 0.71 -0.91 2.44 -0.67 -1.51 0.00 0.00 177.10 177.16 1uqv n ASP 64 N 5.70 1.84 -4.03 -1.22 -0.08 -1.22 -4.88 116.55 112.65 1uqv n ASP 64 Ca 0.19 -0.15 -0.23 0.00 -1.51 0.00 0.00 54.79 53.08 1uqv n ASP 64 Cb 0.48 -1.37 -0.16 0.00 2.34 0.00 0.00 41.12 42.41 1uqv n ASP 64 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1uqv s ILE 65 N 10.45 1.05 0.61 5.18 -1.09 -1.26 -5.12 121.20 131.02 1uqv s ILE 65 Ca 1.10 -0.47 -0.07 0.00 -2.23 0.00 0.00 60.65 58.98 1uqv s ILE 65 Cb -0.56 -0.94 0.13 0.00 -1.58 0.00 0.00 42.46 39.51 1uqv s ILE 65 CO 0.36 0.32 0.84 1.33 -1.23 0.00 0.00 174.94 176.56 1uqv n VAL 66 N 3.50 0.00 0.56 2.92 0.24 -1.26 -4.64 118.33 119.64 1uqv n VAL 66 Ca -0.20 -0.87 0.13 0.00 -2.04 0.00 0.00 64.34 61.35 1uqv n VAL 66 Cb 0.53 -1.39 0.35 0.00 -1.47 0.00 0.00 33.84 31.86 1uqv n VAL 66 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1uqv h GLY 67 N -0.89 0.00 2.00 7.63 0.00 -1.72 -3.16 103.07 106.93 1uqv h GLY 67 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1uqv h GLY 67 CO 0.23 0.00 0.00 1.34 0.00 0.00 0.00 176.54 178.11 1uqv n ASP 68 N -2.37 0.61 -0.35 0.19 2.03 -1.25 -2.94 116.55 112.47 1uqv n ASP 68 Ca 0.05 0.58 0.09 0.00 0.52 0.00 0.00 54.79 56.03 1uqv n ASP 68 Cb 0.45 -0.73 -0.02 0.00 -0.72 0.00 0.00 41.12 40.09 1uqv n ASP 68 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1uqv n LEU 69 N -2.09 1.65 0.08 -2.67 4.32 -1.19 -4.39 117.00 112.71 1uqv n LEU 69 Ca 0.05 -0.71 -0.13 0.00 -0.02 0.00 0.00 56.01 55.20 1uqv n LEU 69 Cb 0.36 0.00 -0.08 0.00 -1.62 0.00 0.00 43.42 42.08 1uqv n LEU 69 CO 0.27 0.32 0.80 -0.07 -1.22 0.00 0.00 177.39 177.48 1uqv h LEU 70 N 1.72 -0.12 -0.18 2.23 3.38 -1.62 -1.57 115.31 119.15 1uqv h LEU 70 Ca 0.00 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1uqv h LEU 70 Cb 0.61 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1uqv h LEU 70 CO 0.00 -0.01 0.00 1.55 0.09 0.00 0.00 178.44 180.07 1uqv h PRO 71 N -0.22 0.00 0.02 1.13 0.13 -1.79 -3.20 132.00 128.08 1uqv h PRO 71 Ca -0.01 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.90 1uqv h PRO 71 Cb 0.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.29 1uqv h PRO 71 CO 0.02 0.00 -1.00 1.49 -0.23 0.00 0.00 178.00 178.28 1uqv h GLU 72 N 0.00 0.08 -5.81 0.86 4.57 -1.72 -3.44 114.58 109.13 1uqv h GLU 72 Ca 0.00 -0.12 -0.57 0.00 -1.18 0.00 0.00 59.36 57.49 1uqv h GLU 72 Cb 0.76 0.04 -0.07 0.00 -0.16 0.00 0.00 28.75 29.32 1uqv h GLU 72 CO 0.00 1.01 -0.07 -0.51 -1.18 0.00 0.00 179.01 178.26 1uqv s LEU 73 N -6.96 4.28 0.00 1.64 1.43 -0.61 -5.08 118.68 113.39 1uqv s LEU 73 Ca -0.01 0.91 -0.00 0.00 -1.03 0.00 0.00 54.13 54.00 1uqv s LEU 73 Cb 0.10 -2.80 0.00 0.00 0.03 0.00 0.00 46.19 43.52 1uqv s LEU 73 CO 0.83 -0.04 0.02 0.00 0.23 0.00 0.00 176.35 177.38 1uqv n LEU 75 N 0.00 0.24 0.31 0.00 7.99 -1.26 -3.08 117.00 121.20 1uqv n LEU 75 Ca 0.00 0.59 -0.12 0.00 -0.01 0.00 0.00 56.01 56.47 1uqv n LEU 75 Cb 0.01 -0.60 -0.06 0.00 -0.11 0.00 0.00 43.42 42.66 1uqv n LEU 75 CO 0.01 -0.58 0.50 -0.61 -1.51 0.00 0.00 177.39 175.20 1uqv h GLN 76 N 0.00 -0.76 -0.15 3.23 5.75 -2.00 -0.77 115.11 120.41 1uqv h GLN 76 Ca 0.00 0.05 -0.02 0.00 -0.15 0.00 0.00 58.65 58.53 1uqv h GLN 76 Cb 0.10 0.17 -0.01 0.00 1.07 0.00 0.00 27.48 28.82 1uqv h GLN 76 CO 0.00 -0.51 0.00 0.22 -2.65 0.00 0.00 178.83 175.89 1uqv h ASP 77 N -0.82 0.19 -0.78 -0.69 3.58 -1.90 -2.06 116.42 113.95 1uqv h ASP 77 Ca -0.08 -0.02 -0.04 0.00 0.42 0.00 0.00 57.03 57.31 1uqv h ASP 77 Cb 0.61 -0.05 -0.04 0.00 1.72 0.00 0.00 39.33 41.57 1uqv h ASP 77 CO 0.13 0.23 0.35 0.00 -2.88 0.00 0.00 179.24 177.08 1uqv h GLN 79 N 1.13 0.78 0.00 0.00 4.15 -0.46 -2.79 115.11 117.92 1uqv h GLN 79 Ca 0.27 -0.50 -0.03 0.00 0.77 0.00 0.00 58.65 59.16 1uqv h GLN 79 Cb 0.15 0.06 -0.00 0.00 0.21 0.00 0.00 27.48 27.90 1uqv h GLN 79 CO -0.03 1.12 -0.17 0.22 -1.93 0.00 0.00 178.83 178.05 1uqv h ASP 80 N 0.60 0.00 1.28 -0.69 1.82 -1.08 -1.29 116.42 117.06 1uqv h ASP 80 Ca 0.01 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.65 1uqv h ASP 80 Cb 1.14 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.15 1uqv h ASP 80 CO 0.12 0.17 0.00 0.18 -1.61 0.00 0.00 179.24 178.09 1uqv n LEU 81 N -3.65 0.56 -4.92 2.28 4.32 -0.32 -4.82 117.00 110.45 1uqv n LEU 81 Ca -0.01 0.56 -0.20 0.00 -0.02 0.00 0.00 56.01 56.33 1uqv n LEU 81 Cb 0.29 -0.39 -0.02 0.00 -1.62 0.00 0.00 43.42 41.68 1uqv n LEU 81 CO 0.32 -0.15 -0.01 0.00 -1.22 0.00 0.00 177.39 176.33 1uqv h ASP 83 N 1.06 0.00 0.00 0.00 5.19 -1.88 -3.43 116.42 117.36 1uqv h ASP 83 Ca -0.45 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.96 1uqv h ASP 83 Cb 1.26 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.77 1uqv h ASP 83 CO 0.55 0.00 0.00 0.61 -3.12 0.00 0.00 179.24 177.28 1uqv n GLY 84 N -0.98 0.05 3.73 2.75 0.00 -1.26 -5.12 105.19 104.36 1uqv n GLY 84 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 1uqv n GLY 84 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1uqv s ASP 85 N 0.00 7.37 -0.11 1.61 -1.08 -1.26 -4.97 116.67 118.23 1uqv s ASP 85 Ca 0.00 1.97 -0.28 0.00 -0.52 0.00 0.00 52.55 53.72 1uqv s ASP 85 Cb 0.00 -2.60 -0.25 0.00 -1.46 0.00 0.00 42.92 38.62 1uqv s ASP 85 CO 0.00 -0.15 0.90 0.25 0.52 0.00 0.00 175.17 176.70 1uqv h LEU 86 N 5.27 0.01 -0.92 -1.34 5.85 -2.00 -3.30 115.31 118.89 1uqv h LEU 86 Ca -0.44 -0.87 0.24 0.00 0.84 0.00 0.00 57.88 57.66 1uqv h LEU 86 Cb 1.21 -0.00 -0.13 0.00 0.37 0.00 0.00 40.66 42.10 1uqv h LEU 86 CO 0.72 0.88 0.40 0.78 -0.34 0.00 0.00 178.44 180.88 1uqv h ASN 87 N -0.85 0.32 -0.17 1.25 -0.26 -2.00 0.45 115.58 114.32 1uqv h ASN 87 Ca -0.00 0.17 0.02 0.00 -0.56 0.00 0.00 56.30 55.93 1uqv h ASN 87 Cb 0.88 0.15 -0.02 0.00 -1.06 0.00 0.00 38.32 38.27 1uqv h ASN 87 CO 0.00 -0.05 0.02 0.50 -1.06 0.00 0.00 177.43 176.85 1uqv h LYS 88 N 0.36 0.08 -0.18 0.81 1.63 -1.99 -1.98 116.57 115.30 1uqv h LYS 88 Ca 0.59 -0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 60.36 1uqv h LYS 88 Cb 1.18 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.79 1uqv h LYS 88 CO -0.56 0.05 0.01 0.00 -3.45 0.00 0.00 179.45 175.50 1uqv h ALA 89 N 1.13 1.67 0.34 5.00 0.00 -1.03 -2.66 119.26 123.72 1uqv h ALA 89 Ca 0.08 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1uqv h ALA 89 Cb 0.08 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1uqv h ALA 89 CO -0.11 0.25 -0.16 0.82 0.00 0.00 0.00 179.25 180.04 1uqv h ILE 90 N 0.26 0.67 -0.74 0.00 2.04 -0.54 -1.71 117.51 117.50 1uqv h ILE 90 Ca 0.06 -0.09 0.05 0.00 1.00 0.00 0.00 64.86 65.89 1uqv h ILE 90 Cb 0.17 0.72 -0.05 0.00 -0.74 0.00 0.00 36.82 36.93 1uqv h ILE 90 CO 0.00 0.02 0.49 0.11 0.00 0.00 0.00 178.15 178.77 1uqv h LYS 91 N -0.51 0.80 0.93 2.37 1.79 -1.28 -1.89 116.57 118.78 1uqv h LYS 91 Ca -0.05 -0.05 -0.04 0.00 -2.18 0.00 0.00 60.65 58.33 1uqv h LYS 91 Cb 0.38 -0.18 0.01 0.00 -1.58 0.00 0.00 32.23 30.86 1uqv h LYS 91 CO 0.08 0.53 -0.47 0.35 -1.08 0.00 0.00 179.45 178.86 1uqv h PHE 92 N 0.82 -1.22 -0.94 -1.35 3.57 -1.13 -2.24 116.94 114.46 1uqv h PHE 92 Ca 0.31 -0.03 0.16 0.00 3.53 0.00 0.00 57.97 61.94 1uqv h PHE 92 Cb 0.19 0.41 -0.08 0.00 2.79 0.00 0.00 35.95 39.26 1uqv h PHE 92 CO -0.00 -0.74 0.60 -0.22 -2.23 0.00 0.00 178.31 175.71 1uqv h LYS 93 N -1.27 0.70 0.38 1.11 1.63 -1.10 -2.64 116.57 115.39 1uqv h LYS 93 Ca -0.13 -0.04 -0.02 0.00 -0.85 0.00 0.00 60.65 59.61 1uqv h LYS 93 Cb 0.98 -0.16 -0.00 0.00 -0.60 0.00 0.00 32.23 32.45 1uqv h LYS 93 CO 0.19 0.46 -0.24 0.82 -3.45 0.00 0.00 179.45 177.24 1uqv h ILE 94 N 0.72 0.00 -1.31 2.00 2.04 -1.13 -1.65 117.51 118.18 1uqv h ILE 94 Ca 0.49 0.00 0.38 0.00 1.00 0.00 0.00 64.86 66.73 1uqv h ILE 94 Cb 0.77 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.78 1uqv h ILE 94 CO -0.25 0.00 0.91 -0.07 0.00 0.00 0.00 178.15 178.75 1uqv h LEU 95 N -0.58 0.13 -0.24 1.44 3.38 -1.14 0.43 115.31 118.72 1uqv h LEU 95 Ca -0.05 0.04 -0.11 0.00 0.09 0.00 0.00 57.88 57.85 1uqv h LEU 95 Cb 0.47 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.24 1uqv h LEU 95 CO 0.05 -0.01 -0.27 0.40 0.09 0.00 0.00 178.44 178.70 1uqv h ILE 96 N 0.09 1.32 -0.45 1.22 2.04 -1.11 -2.24 117.51 118.39 1uqv h ILE 96 Ca 0.68 -1.44 0.06 0.00 1.00 0.00 0.00 64.86 65.16 1uqv h ILE 96 Cb 2.42 1.70 -0.06 0.00 -0.74 0.00 0.00 36.82 40.15 1uqv h ILE 96 CO -0.13 0.45 0.13 -1.13 0.00 0.00 0.00 178.15 177.46 1uqv h ASN 97 N 0.31 0.09 -0.12 1.72 -1.24 0.80 -1.01 115.58 116.12 1uqv h ASN 97 Ca 0.03 0.06 -0.06 0.00 0.71 0.00 0.00 56.30 57.04 1uqv h ASN 97 Cb 0.83 0.07 -0.02 0.00 0.73 0.00 0.00 38.32 39.93 1uqv h ASN 97 CO 0.06 0.08 -0.10 0.11 -1.29 0.00 0.00 177.43 176.29 1uqv h LYS 98 N 0.28 0.46 -0.80 6.67 6.56 -1.48 -2.49 116.57 125.77 1uqv h LYS 98 Ca 0.21 -0.12 -0.00 0.00 -1.06 0.00 0.00 60.65 59.68 1uqv h LYS 98 Cb 0.24 -0.05 -0.04 0.00 -0.57 0.00 0.00 32.23 31.81 1uqv h LYS 98 CO -0.25 0.57 0.49 1.98 -2.06 0.00 0.00 179.45 180.18 1uqv h MET 99 N 0.43 1.07 -0.31 3.15 4.05 -0.57 -1.36 114.93 121.39 1uqv h MET 99 Ca 0.08 -0.09 -0.14 0.00 -0.28 0.00 0.00 59.70 59.27 1uqv h MET 99 Cb 0.45 -0.23 -0.00 0.00 -0.80 0.00 0.00 31.60 31.01 1uqv h MET 99 CO 0.02 0.75 -0.37 -0.09 0.23 0.00 0.00 176.91 177.45 1uqv h ARG 100 N 1.10 0.80 -0.68 0.39 2.43 -0.93 -3.11 114.38 114.38 1uqv h ARG 100 Ca 0.29 -0.45 -0.03 0.00 -0.81 0.00 0.00 59.98 58.98 1uqv h ARG 100 Cb -0.06 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.48 1uqv h ARG 100 CO -0.06 1.08 0.30 -0.44 -1.51 0.00 0.00 179.97 179.35 1uqv h ASP 101 N 0.57 0.89 -0.97 -3.80 3.32 -1.10 -3.45 116.42 111.88 1uqv h ASP 101 Ca 0.04 -0.11 -0.18 0.00 0.02 0.00 0.00 57.03 56.81 1uqv h ASP 101 Cb 0.96 -0.23 -0.07 0.00 0.22 0.00 0.00 39.33 40.21 1uqv h ASP 101 CO 0.09 0.77 -0.16 -1.54 -1.72 0.00 0.00 179.24 176.67 1uqv n SER 102 N -4.32 -3.44 -2.92 6.45 3.41 -0.55 -3.40 113.62 108.84 1uqv n SER 102 Ca 0.06 0.22 -0.03 0.00 -0.26 0.00 0.00 58.87 58.87 1uqv n SER 102 Cb 0.15 -2.90 0.00 0.00 -0.26 0.00 0.00 64.21 61.20 1uqv n SER 102 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1uqv n LYS 103 N -1.10 -2.34 0.00 4.33 4.81 -1.26 -5.03 118.16 117.57 1uqv n LYS 103 Ca -0.09 2.05 0.00 0.00 -0.87 0.00 0.00 58.31 59.40 1uqv n LYS 103 Cb 0.38 -3.89 0.00 0.00 0.02 0.00 0.00 35.03 31.54 1uqv n LYS 103 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 1uqv n LEU 104 N 0.76 0.00 -2.67 3.14 7.94 -1.22 -5.00 117.00 119.95 1uqv n LEU 104 Ca 0.01 0.00 -0.02 0.00 -1.11 0.00 0.00 56.01 54.88 1uqv n LEU 104 Cb 0.23 0.00 0.13 0.00 0.53 0.00 0.00 43.42 44.31 1uqv n LEU 104 CO 0.32 0.00 0.64 1.21 -1.11 0.00 0.00 177.39 178.44 1uqv n GLU 105 N -1.44 1.37 0.00 1.96 2.13 -1.26 -4.92 120.64 118.47 1uqv n GLU 105 Ca 0.00 -1.22 0.00 0.00 0.66 0.00 0.00 57.16 56.60 1uqv n GLU 105 Cb 0.00 0.42 0.00 0.00 0.27 0.00 0.00 31.44 32.13 1uqv n GLU 105 CO 0.00 0.00 0.00 0.91 -0.41 0.00 0.00 177.13 177.63 1uqv n TRP 106 N -1.54 0.00 -3.84 4.31 8.01 -1.26 -4.95 117.44 118.17 1uqv n TRP 106 Ca -0.18 -0.33 -0.30 0.00 -1.31 0.00 0.00 57.50 55.38 1uqv n TRP 106 Cb 0.88 -0.03 -0.15 0.00 -2.01 0.00 0.00 31.31 29.99 1uqv n TRP 106 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.69 176.83 1uqv s LYS 107 N -0.66 1.06 0.00 -0.99 -0.14 -1.26 -5.20 119.74 112.55 1uqv s LYS 107 Ca 0.00 -1.20 0.09 0.00 -1.36 0.00 0.00 55.97 53.49 1uqv s LYS 107 Cb 0.00 -2.40 0.07 0.00 -1.68 0.00 0.00 37.83 33.82 1uqv s LYS 107 CO 0.00 -0.88 0.78 -0.25 -0.76 0.00 0.00 175.35 174.24